AI36078
1449133-12-3 | 3-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2-propyn-1-ol
Manufacturer: A2B Chem
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CatalogNumber
AI36078
ChemicalName
3-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2-propyn-1-ol
CasNumber
1449133-12-3
MolecularFormula
C15H19BO3
MolecularWeight
258.1206
MdlNumber
MFCD16294528
Smiles
OCC#Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
367
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AI36078
ChemicalName: 3-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2-propyn-1-ol
CasNumber: 1449133-12-3
MolecularFormula: C15H19BO3
MolecularWeight: 258.1206
MdlNumber: MFCD16294528
Smiles: OCC#Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 367
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AI36078
ChemicalName:
3-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2-propyn-1-ol
CasNumber:
1449133-12-3
MolecularFormula:
C15H19BO3
MolecularWeight:
258.1206
MdlNumber:
MFCD16294528
Smiles:
OCC#Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
367
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
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Smiles: CC1CCCN(C1)C(=O)c1cc(F)cc(c1)B(O)O
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Smiles:
CC1CCCN(C1)C(=O)c1cc(F)cc(c1)B(O)O
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Smiles: Fc1cc(cc(c1)B(O)O)C(=O)Nc1c(C)cccc1Cl
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Fc1cc(cc(c1)B(O)O)C(=O)Nc1c(C)cccc1Cl
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Smiles: COc1ccc(cc1)NC(=O)c1cc(F)cc(c1)B(O)O
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Smiles:
COc1ccc(cc1)NC(=O)c1cc(F)cc(c1)B(O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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